SCHEMBL29220255

SCHEMBL29220255

CCCC(CC)CC1(C(=O)O)CC=CCC1(CC(CC)CCC)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5645403 0.90 CA2 (0.41) TDP1
SCHEMBL5646606 0.86 CA2 (0.38) TDP1
SCHEMBL5647557 0.85 CA2 (0.37) TDP1
SCHEMBL5646997 0.85 CA2 (0.37) TDP1
SCHEMBL5646165 0.85 CA2 (0.37) TDP1
SCHEMBL5645948 0.81 CA2 (0.36) CHRM1DRD3SLC6A3TDP1
SCHEMBL5648181 0.78 CA2 (0.35) TDP1
SCHEMBL5645267 0.77 CA2 (0.34) TDP1
SCHEMBL5648548 0.72 CA2 (0.33) TDP1
SCHEMBL5645601 0.72 CA2 (0.35) TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108888-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed
CN-118108888-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed